BSDY31 -OEChem-04022108153D 29 32 0 0 0 0 0 0 0999 V2000 -6.0699 -1.1164 0.0001 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.2232 2.7475 -0.0002 O 0 0 0 0 0 0 0 0 0 0 0 0 4.8983 -0.1674 -0.0008 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3214 -0.7861 0.0007 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 1.3613 0.0003 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8682 0.5362 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3921 1.1425 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6874 -1.0312 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8105 1.5279 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 0.6138 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6271 -1.9625 0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6867 0.0482 0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1250 2.5012 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8461 -2.4036 -0.0005 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5512 -2.9866 -0.0001 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3699 0.3557 -1.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3701 0.3563 1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6659 -0.1599 -1.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6661 -0.1593 1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3140 -0.4174 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4533 -1.9953 0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7830 2.1730 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7475 3.3853 -0.0012 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7904 -2.9306 -0.0011 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3171 -4.0419 -0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8786 0.5496 -2.1588 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8789 0.5507 2.1584 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1566 -0.3559 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1569 -0.3547 2.1579 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 2 9 1 0 0 0 0 2 13 1 0 0 0 0 3 12 2 0 0 0 0 4 6 1 0 0 0 0 4 8 1 0 0 0 0 4 11 1 0 0 0 0 5 9 1 0 0 0 0 5 12 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 9 2 0 0 0 0 7 10 1 0 0 0 0 7 13 2 0 0 0 0 8 12 1 0 0 0 0 8 14 2 0 0 0 0 10 16 2 0 0 0 0 10 17 1 0 0 0 0 11 15 2 0 0 0 0 11 21 1 0 0 0 0 13 23 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 25 1 0 0 0 0 16 18 1 0 0 0 0 16 26 1 0 0 0 0 17 19 2 0 0 0 0 17 27 1 0 0 0 0 18 20 2 0 0 0 0 18 28 1 0 0 0 0 19 20 1 0 0 0 0 19 29 1 0 0 0 0 M END $$$$